ethyl (1R,2S,3S)-1,3-dicyano-3-methyl-4-oxidanylidene-2-(2-oxidanylidenepropyl)cyclopentane-1-carboxylate

Systemtic Name: ethyl (1R,2S,3S)-1,3-dicyano-3-methyl-4-oxidanylidene-2-(2-oxidanylidenepropyl)cyclopentane-1-carboxylate Openeye Name: ethyl (1R,2S,3S)-2-acetonyl-1,3-dicyano-3-methyl-4-oxo-cyclopentanecarboxylate CAS Name: (1R,2S,3S)-1,3-dicyano-3-methyl-4-oxo-2-(2-oxopropyl)-1-cyclopentanecarboxylic acid ethyl ester IUPAC Name: ethyl (1R,2S,3S)-1,3-dicyano-3-methyl-4-oxo-2-(2-oxopropyl)cyclopentane-1-carboxylate Traditional Name: (1R,2S,3S)-2-acetonyl-1,3-dicyano-4-keto-3-methyl-cyclopentanecarboxylic acid ethyl ester Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(=O)C(C1CC(=O)C)(C)C#N)C#N

Isomeric SMILES

CCOC(=O)[C@@]1(CC(=O)[C@]([C@@H]1CC(=O)C)(C)C#N)C#N

InChI

InChI=1S/C14H16N2O4/c1-4-20-12(19)14(8-16)6-11(18)13(3,7-15)10(14)5-9(2)17/h10H,4-6H2,1-3H3/t10-,13+,14-/m0/s1